Jurgens H. De Lange

Lynnwood Road
Pretoria, GT 0002, South Africa

Last Updated: 09/26/2026

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Found 13 publications

All-body concept and quantified limits of cooperativity and related effects in homodromic cyclic water clusters from a molecular-wide and electron density-based approach.

All-body concept and quantified limits of cooperativity and related effects in homodromic cyclic water clusters from a molecular-wide and electron density-based approach.

Journal: Journal of computational chemistry

Published: May 16, 2024

Scurvy masquerading as IgA vasculitis.

Scurvy masquerading as IgA vasculitis.

Journal: Pediatric rheumatology online journal

Published: December 22, 2023

The CH···HC interaction in biphenyl is a delocalized, molecular-wide and entirely non-classical interaction: Results from FALDI analysis.

The CH···HC interaction in biphenyl is a delocalized, molecular-wide and entirely non-classical interaction: Results from FALDI analysis.

Journal: Journal of computational chemistry

Published: October 10, 2020

Characterization of bonding modes in metal complexes through electron density cross-sections.

Characterization of bonding modes in metal complexes through electron density cross-sections.

Journal: Journal of computational chemistry

Published: July 21, 2020

Molecular Orbitals Support Energy-Stabilizing "Bonding" Nature of Bader's Bond Paths.

Molecular Orbitals Support Energy-Stabilizing "Bonding" Nature of Bader's Bond Paths.

Journal: The journal of physical chemistry. A

Published: June 11, 2020

Origin of Hydrocarbons Stability from a Computational Perspective: A Case Study of Ortho-Xylene Isomers.

Origin of Hydrocarbons Stability from a Computational Perspective: A Case Study of Ortho-Xylene Isomers.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry

Published: January 24, 2020

Quantifying individual (anti)bonding molecular orbitals' contributions to chemical bonding.

Quantifying individual (anti)bonding molecular orbitals' contributions to chemical bonding.

Journal: Physical chemistry chemical physics : PCCP

Published: September 19, 2019

FALDI-based criterion for and the origin of an electron density bridge with an associated (3,-1) critical point on Bader's molecular graph.

FALDI-based criterion for and the origin of an electron density bridge with an associated (3,-1) critical point on Bader's molecular graph.

Journal: Journal of computational chemistry

Published: June 05, 2018

Exact and exclusive electron localization indices within QTAIM atomic basins.

Exact and exclusive electron localization indices within QTAIM atomic basins.

Journal: Journal of computational chemistry

Published: January 16, 2018

FALDI-based decomposition of an atomic interaction line leads to 3D representation of the multicenter nature of interactions.

FALDI-based decomposition of an atomic interaction line leads to 3D representation of the multicenter nature of interactions.

Journal: Journal of computational chemistry

Published: November 02, 2017

Gold(I) Hydrides as Proton Acceptors in Dihydrogen Bond Formation.

Gold(I) Hydrides as Proton Acceptors in Dihydrogen Bond Formation.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry

Published: April 11, 2017

Toward deformation densities for intramolecular interactions without radical reference states using the fragment, atom, localized, delocalized, and interatomic (FALDI) charge density decomposition scheme.

Toward deformation densities for intramolecular interactions without radical reference states using the fragment, atom, localized, delocalized, and interatomic (FALDI) charge density decomposition scheme.

Journal: Journal of computational chemistry

Published: November 03, 2016

Showing 1-12 of 13

Last Updated: 09/26/2026